Products 1974271-78-7

CAS 1974271-78-7 is the registry number for Sulfo-QSY21-NHS. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

1-[9-[2-[4-(2,5-dioxopyrrolidin-1-yl)oxycarbonylpiperidin-1-yl]sulfonylphenyl]-6-(5-sulfo-2,3-dihydroindol-1-ium-1-ylidene)xanthen-3-yl]-2,3-dihydroindole-5-sulfonic acid chloride (CAS 1974271-78-7) is a chemical compound with the molecular formula C45H39ClN4O13S3 and a molecular weight of 975.5 g/mol. IUPAC name: 1-[9-[2-[4-(2,5-dioxopyrrolidin-1-yl)oxycarbonylpiperidin-1-yl]sulfonylphenyl]-6-(5-sulfo-2,3-dihydroindol-1-ium-1-ylidene)xanthen-3-yl]-2,3-dihydroindole-5-sulfonic acid chloride. InChIKey: GXCGJHGIWCKXTJ-UHFFFAOYSA-N.

Identity
Molecular formulaC45H39ClN4O13S3
Molecular weight975.5 g/mol
IUPAC name1-[9-[2-[4-(2,5-dioxopyrrolidin-1-yl)oxycarbonylpiperidin-1-yl]sulfonylphenyl]-6-(5-sulfo-2,3-dihydroindol-1-ium-1-ylidene)xanthen-3-yl]-2,3-dihydroindole-5-sulfonic acid chloride
InChIKeyGXCGJHGIWCKXTJ-UHFFFAOYSA-N
SMILESC1CN(CCC1C(=O)ON2C(=O)CCC2=O)S(=O)(=O)C3=CC=CC=C3C4=C5C=CC(=[N+]6CCC7=C6C=CC(=C7)S(=O)(=O)O)C=C5OC8=C4C=CC(=C8)N9CCC1=C9C=CC(=C1)S(=O)(=O)O.[Cl-]

Computed by PubChem (NCBI)